SCHEMBL18471978

SCHEMBL18471978

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)Oc1cc(O)cc(O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 2/20 0.57
▸ NR1I2 O75469 2/20 0.57
▸ PTGS2 P35354 2/20 0.57
▸ PGR P06401 1/20 0.57
▸ PDE4D Q08499 1/20 0.57
▸ ALDH1A1 P00352 7/20 0.51
▸ CYP19A1 P11511 4/20 0.51
▸ F7 P08709 3/20 0.51
▸ F3 P13726 3/20 0.51
▸ PPARG P37231 3/20 0.51
▸ OXER1 Q8TDS5 3/20 0.51
▸ PTGS1 P23219 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ PPARD Q03181 2/20 0.51
▸ PPARA Q07869 2/20 0.51
▸ RXRA P19793 2/20 0.51
▸ CYP3A4 P08684 2/20 0.51
▸ ALOX15 P16050 2/20 0.51
▸ HSD17B10 Q99714 2/20 0.51
▸ TDP1 Q9NUW8 2/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13468282 0.97 ADORA3 (0.53) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL18471979 0.91 ALDH1A1 (0.49) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL18471980 0.89 ADORA3 (0.49) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL17212394 0.88 ALDH1A1 (0.49) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL17212642 0.84 ALDH1A1 (0.51) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL29466470 0.84 ALDH1A1 (0.51) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL18487106 0.83 ALDH1A1 (0.44) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL18471974 0.83 ALDH1A1 (0.44) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL2519158 0.82 ALDH1A1 (0.52) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL2518096 0.82 ALDH1A1 (0.52) ADORA3NR1I2PTGS2PGRPDE4D

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11014947-B2 Lipophenol compounds and uses thereof INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2021-05-25 — — US disclosed
US-10011620-B2 Lipophenol compounds and uses thereof INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2018-07-03 — — US disclosed
US-10011620-B2 Lipophenol compounds and uses thereof INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2018-07-03 — — US disclosed
US-20170037067-A1 NEW LIPOPHENOL COMPOUNDS AND USES THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2017-02-09 — — US disclosed
US-20170037067-A1 NEW LIPOPHENOL COMPOUNDS AND USES THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2017-02-09 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11014947-B2 Lipophenol compounds and uses thereof LPO, CBR1, LCLAT1 ADORA3 2717/4885NR1I2 896/4885PTGS2 1294/4885
US-20170037067-A1 NEW LIPOPHENOL COMPOUNDS AND USES THEREOF LCLAT1, CBR1, LPO ADORA3 2736/4885NR1I2 720/4885PTGS2 1650/4885
US-10011620-B2 Lipophenol compounds and uses thereof LPO, CBR1, LCLAT1 ADORA3 2717/4885NR1I2 896/4885PTGS2 1294/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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